1-[3-(dimethylsulfamoyl)phenyl]-3-[2-(thiophen-3-ylmethylsulfanyl)ethyl]thiourea

Systemtic Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[2-(thiophen-3-ylmethylsulfanyl)ethyl]thiourea Openeye Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[2-(3-thienylmethylsulfanyl)ethyl]thiourea CAS Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[2-(3-thiophenylmethylthio)ethyl]thiourea IUPAC Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[2-(thiophen-3-ylmethylsulfanyl)ethyl]thiourea Traditional Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[2-(3-thenylthio)ethyl]thiourea Formula: C16H21N3O2S4 MolecularWeight: 415.61684

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=S)NCCSCC2=CSC=C2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=S)NCCSCC2=CSC=C2

InChI

InChI=1S/C16H21N3O2S4/c1-19(2)25(20,21)15-5-3-4-14(10-15)18-16(22)17-7-9-24-12-13-6-8-23-11-13/h3-6,8,10-11H,7,9,12H2,1-2H3,(H2,17,18,22)